| SpectraBase Spectrum ID |
HR3j4TKHV4R |
| Name |
3-Pyridinecarboxylic acid, 5-(tricyclo[3.3.1.13,7]dec-1-ylthio)- |
| CAS Registry Number |
101392-33-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19NO2S |
| InChI |
InChI=1S/C16H19NO2S/c18-15(19)13-4-14(9-17-8-13)20-16-5-10-1-11(6-16)3-12(2-10)7-16/h4,8-12H,1-3,5-7H2,(H,18,19) |
| InChIKey |
JWRFDYWAWZYLLD-UHFFFAOYSA-N |
| Molecular Weight |
289.393 g/mol |
| SMILES |
OC(c1cc(SC23CC4CC(C3)CC(C2)C4)cnc1)=O |
| SPLASH |
splash10-000i-0900000000-3238ca4e6ee5429adc86 |
| Source of Spectrum |
Y-22-775-15 |
| Synonyms |
3-Hydroxycarbonyl-5-(1-adamantylthio)pyridine
5-(1-adamantylsulfanyl)nicotinic acid
5-(1-Adamantylthio)nicotinic acid |
| Wiley ID |
1292612 |
![3-Pyridinecarboxylic acid, 5-(tricyclo[3.3.1.13,7]dec-1-ylthio)-](/api/spectrum/HR3j4TKHV4R/structure.png?h=300&w=458 "3-Pyridinecarboxylic acid, 5-(tricyclo[3.3.1.13,7]dec-1-ylthio)-")
